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DocumentationIdentifier: MM221541
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM221541 |
| SMILES |
CN(CC(=N)N)C(C)(C)C
|
| InChIKey |
CRKWTMFJCMPQQT-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
0.65
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM133603
Similarity: 0.8261
Similarity to MM133603
| Tanimoto metric | 0.8261 |
|---|---|
| Cosine metric | 0.9089 |
| Dice metric | 0.9048 |
| MW: | 129.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM245024
Similarity: 0.6667
Similarity to MM245024
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8004 |
| Dice metric | 0.8 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM268540
Similarity: 0.6496
Similarity to MM268540
| Tanimoto metric | 0.6496 |
|---|---|
| Cosine metric | 0.7884 |
| Dice metric | 0.7876 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+132 more
